The catalytic mechanism of peptidylglycine α-hydroxylating monooxygenase investigated by computer simulation

Journal of the American Chemical Society

Volumn 128, Issue 39, 2006, Pages 12817-12828

  Crespo, Alejandro ^a,b   Martí, Marcelo A ^a   Roitberg, Adrian E ^b   Amzel, L Mario ^c   Estrin, Darío A ^a  

^a UNIVERSIDAD DE BUENOS AIRES   (Argentina)

^b University of Florida ^*  (United States)

^c JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CYTOCHROME P450 ENZYMES; ELECTRON TRANSFER (ET); PEPTIDYLGLYCINE Α-HYDROXYLATING MONOOXYGENASE (PHM); QUANTUM-CLASSICAL (QM-MM);

ACTIVATION ENERGY; CATALYSTS; COMPUTER SIMULATION; GROUND STATE; HYDROXYLATION; POSITIVE IONS; PROTEINS; QUANTUM THEORY;

GLYCEROL;

ASCORBIC ACID; CYTOCHROME P450; GLYCINE; HYDROGEN; PEPTIDYLGLYCINE ALPHA HYDROXYLATING MONOOXYGENASE; PROTON; REACTIVE OXYGEN METABOLITE; SOLVENT; UNCLASSIFIED DRUG; UNSPECIFIC MONOOXYGENASE;

ARTICLE; CARBOXY TERMINAL SEQUENCE; CATALYSIS; CHEMICAL BINDING; COMPUTER SIMULATION; ELECTRON TRANSPORT; ENERGY; ENTHALPY; HYDROXYLATION; QUANTUM MECHANICS; REDUCTION;

CATALYSIS; COMPUTER SIMULATION; HYDROGEN; HYDROXYLATION; KINETICS; MIXED FUNCTION OXYGENASES; MODELS, MOLECULAR; MULTIENZYME COMPLEXES; OXYGEN; QUANTUM THEORY; THERMODYNAMICS;

EID: 33749526867     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja062876x     Document Type: Article

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